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SMILES: COc1ccccc1-c1nccn1-c1ccc(cc1)N1c2ccc3ccccc3c2NC(=O)CC1=O

InChI Key: InChIKey=JFZRJOKDVNYKNW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 366052   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
P2X purinoceptor 4


(Homo sapiens (Human))		BDBM366052
PNG
(US9873683, Example 51)
Show SMILES COc1ccccc1-c1nccn1-c1ccc(cc1)N1c2ccc3ccccc3c2NC(=O)CC1=O
Show InChI InChI=1S/C29H22N4O3/c1-36-25-9-5-4-8-23(25)29-30-16-17-32(29)20-11-13-21(14-12-20)33-24-15-10-19-6-2-3-7-22(19)28(24)31-26(34)18-27(33)35/h2-17H,18H2,1H3,(H,31,34)
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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US Patent
n/an/a 1.70E+3n/an/an/an/an/an/a



Duquesne University



Assay Description
The 1321N1 cells stably expressing human P2X4 receptor were seeded on a 96-well plate, cultured under the conditions of 37° C. and 5% CO2 for 24 hour...

J Med Chem 51: 68-76 (2008)


BindingDB Entry DOI: 10.7270/Q2MW2KFS
More data for this
Ligand-Target Pair